SCHEMBL9854748

SCHEMBL9854748

COc1ccc(O)c(CCOc2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.49
MTNR1B P49286 1/20 0.49
LMNA P02545 4/20 0.48
GAA P10253 2/20 0.48
POLB P06746 1/20 0.48
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
HPGD P15428 2/20 0.45
KCNH2 Q12809 1/20 0.44
TSHR P16473 1/20 0.44
FFAR1 O14842 1/20 0.44
FFAR4 Q5NUL3 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
PKM P14618 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
TP53 P04637 2/20 0.43
MEN1 O00255 2/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15079871 0.82 MAPT (0.51) LMNAGAADRD2DRD4DRD3
SCHEMBL15079796 0.81 MAPK1 (0.50) MTNR1AMTNR1BLMNATSHRNPC1
SCHEMBL8686118 0.81 TDP1 (0.56) MTNR1AMTNR1BLMNAGAAPOLB
SCHEMBL7736570 0.80 LMNA (0.47) MTNR1AMTNR1BLMNAGAAPOLB
SCHEMBL9854724 0.78 KCNA3 (0.52) DRD2DRD4DRD3NPC1RAB9A
SCHEMBL9854773 0.77 MTNR1B (0.54) MTNR1AMTNR1BLMNAHPGDNPC1
SCHEMBL10366349 0.76 MTNR1A (0.56) MTNR1AMTNR1BLMNAGAAPOLB
SCHEMBL28863771 0.76 MTNR1A (0.56) MTNR1AMTNR1BLMNAGAAPOLB
SCHEMBL14131212 0.76 MTNR1A (0.52) MTNR1AMTNR1BLMNAGAAPOLB
SCHEMBL15079427 0.76 LTA4H (0.53) ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0428423-A2 Aryloxy alkyl benzenes, processes for their preparation and pharmaceutical compositions containing them LIPHA S.A. (FR) 1991-05-22 EP claimed
JP-3255043-A None JP disclosed
JP-H03255043-A NOVEL ARYLOXYALKYLBENZENE, ITS PRODUCTION AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LIPHA (LYON IND PHARMACEUT) 1991-11-13 JP disclosed
EP-0428423-A2 Aryloxy alkyl benzenes, processes for their preparation and pharmaceutical compositions containing them LIPHA S.A. (FR) 1991-05-22 EP disclosed